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89508-41-8 | Pyrimidine, 4,6-dibromo-2-(5-methyl-3-thienyl)-
CAS No: 89508-41-8 Catalog No: AG0041EJ MDL No:
Product Description
Catalog Number:
AG0041EJ
Chemical Name:
Pyrimidine, 4,6-dibromo-2-(5-methyl-3-thienyl)-
CAS Number:
89508-41-8
Molecular Formula:
C9H6Br2N2S
Molecular Weight:
334.0303
IUPAC Name:
4,6-dibromo-2-(5-methylthiophen-3-yl)pyrimidine
InChI:
InChI=1S/C9H6Br2N2S/c1-5-2-6(4-14-5)9-12-7(10)3-8(11)13-9/h2-4H,1H3
InChI Key:
SCBUQVJBACQERM-UHFFFAOYSA-N
SMILES:
Brc1cc(Br)nc(n1)c1csc(c1)C
Properties
Complexity:
195
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
333.86g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
334.029g/mol
Monoisotopic Mass:
331.862g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
54A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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